Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 19/20 | 0.58 |
| ▸ | IDH2 | P48735 | 17/20 | 0.58 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL22591168 | 0.93 | IDH1 (0.61) | IDH1IDH2 | |
| SCHEMBL20289880 | 0.92 | IDH1 (0.61) | IDH1IDH2 | |
| SCHEMBL25100452 | 0.90 | IDH1 (0.49) | IDH1IDH2 | |
| SCHEMBL21799147 | 0.88 | IDH1 (0.75) | IDH1IDH2 | |
| SCHEMBL30341788 | 0.88 | IDH1 (0.75) | IDH1IDH2 | |
| SCHEMBL20289610 | 0.88 | IDH1 (0.75) | IDH1IDH2 | |
| SCHEMBL21799145 | 0.88 | IDH1 (0.75) | IDH1IDH2 | |
| SCHEMBL22591188 | 0.85 | IDH1 (0.81) | IDH1IDH2 | |
| SCHEMBL22879074 | 0.83 | IDH1 (0.62) | IDH1IDH2 | |
| SCHEMBL21799109 | 0.82 | IDH1 (0.76) | IDH1IDH2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3763717-A1 | PYRIDO[4,3-D][1,3]OXAZIN-2-ONE AND PYRIMIDO[4,5-D][1,3]OXAZIN-2-ONE COMPOUNDS AS MUTANT IDH1 AND IDH2 INHIBITORS | ELI LILLY AND CO. (US) | 2021-01-13 | — | — | EP | disclosed |
| EP-3555105-B1 | 7-PHENYLETHYLAMINO-4H-PYRIMIDO[4,5-D][1,3]OXAZIN-2-ONE COMPOUNDS AS MUTANT IDH1 AND IDH2 INHIBITORS | LILLY CO ELI (US) | 2020-10-28 | — | — | EP | disclosed |